7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole

C199H264Cl6FNO14 — CID 160942354

IUPAC7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole
SMILESC.C.C.C.C.CC(C)c1cc2c(cc1Cl)OCCC2.CC(C)c1cc2ccoc2cc1Cl.CC(C)c1ccc2c(c1)C(C)(C)CO2.CC(C)c1ccc2c(c1)C(C)(F)CCO2.CC(C)c1ccc2c(c1)CCCO2.CC(C)c1ccc2c(c1)CCO2.CC(C)c1ccc2c(c1Cl)C=CC2.CC(C)c1ccc2c(c1Cl)CCCO2.CC(C)c1ccc2c(c1Cl)OCC2C.CC(C)c1ccc2ccoc2c1Cl.CC(C)c1ccc2occc2c1.CC(C)c1cccc2cc[nH]c12.Cc1c(C(C)C)ccc2c1CCO2.Cc1cc(C(C)C)c(C)c2c1OCCC2.Cc1cc(C(C)C)c(C)c2c1OCCC2.Cc1cc2c(cc1C(C)C)CCCO2
InChIInChI=1S/2C14H20O.C13H17FO.2C13H18O.3C12H15ClO.C12H13Cl.2C12H16O.2C11H11ClO.C11H13N.C11H14O.C11H12O.5CH4/c2*1-9(2)13-8-10(3)14-12(11(13)4)6-5-7-15-14;1-9(2)10-4-5-12-11(8-10)13(3,14)6-7-15-12;1-9(2)10-5-6-12-11(7-10)13(3,4)8-14-12;1-9(2)12-8-11-5-4-6-14-13(11)7-10(12)3;1-7(2)9-4-5-10-8(3)6-14-12(10)11(9)13;1-8(2)9-5-6-11-10(12(9)13)4-3-7-14-11;1-8(2)10-6-9-4-3-5-14-12(9)7-11(10)13;1-8(2)10-7-6-9-4-3-5-11(9)12(10)13;1-8(2)10-4-5-12-11(9(10)3)6-7-13-12;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-7(2)9-5-8-3-4-13-11(8)6-10(9)12;1-7(2)9-4-3-8-5-6-13-11(8)10(9)12;1-8(2)10-5-3-4-9-6-7-12-11(9)10;2*1-8(2)9-3-4-11-10(7-9)5-6-12-11;;;;;/h2*8-9H,5-7H2,1-4H3;4-5,8-9H,6-7H2,1-3H3;5-7,9H,8H2,1-4H3;7-9H,4-6H2,1-3H3;4-5,7-8H,6H2,1-3H3;5-6,8H,3-4,7H2,1-2H3;6-8H,3-5H2,1-2H3;3,5-8H,4H2,1-2H3;4-5,8H,6-7H2,1-3H3;5-6,8-9H,3-4,7H2,1-2H3;2*3-7H,1-2H3;3-8,12H,1-2H3;3-4,7-8H,5-6H2,1-2H3;3-8H,1-2H3;5*1H4
InChIKeySUQYQSAOWOLMQP-UHFFFAOYSA-N
MW3126.01 g/mol
LogP61.15
Rot. Bonds16

About 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole

7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole (PubChem CID 160942354) has the molecular formula C199H264Cl6FNO14 and a molecular weight of 3126.01 g/mol. Its IUPAC name is 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole.

Molecular Properties

Compound Name7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole
PubChem CID160942354
Molecular FormulaC199H264Cl6FNO14
Molecular Weight3126.01 g/mol
Exact Mass3120.81
IUPAC Name7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole
SMILESC.C.C.C.C.CC(C)c1cc2c(cc1Cl)OCCC2.CC(C)c1cc2ccoc2cc1Cl.CC(C)c1ccc2c(c1)C(C)(C)CO2.CC(C)c1ccc2c(c1)C(C)(F)CCO2.CC(C)c1ccc2c(c1)CCCO2.CC(C)c1ccc2c(c1)CCO2.CC(C)c1ccc2c(c1Cl)C=CC2.CC(C)c1ccc2c(c1Cl)CCCO2.CC(C)c1ccc2c(c1Cl)OCC2C.CC(C)c1ccc2ccoc2c1Cl.CC(C)c1ccc2occc2c1.CC(C)c1cccc2cc[nH]c12.Cc1c(C(C)C)ccc2c1CCO2.Cc1cc(C(C)C)c(C)c2c1OCCC2.Cc1cc(C(C)C)c(C)c2c1OCCC2.Cc1cc2c(cc1C(C)C)CCCO2
InChIInChI=1S/2C14H20O.C13H17FO.2C13H18O.3C12H15ClO.C12H13Cl.2C12H16O.2C11H11ClO.C11H13N.C11H14O.C11H12O.5CH4/c2*1-9(2)13-8-10(3)14-12(11(13)4)6-5-7-15-14;1-9(2)10-4-5-12-11(8-10)13(3,14)6-7-15-12;1-9(2)10-5-6-12-11(7-10)13(3,4)8-14-12;1-9(2)12-8-11-5-4-6-14-13(11)7-10(12)3;1-7(2)9-4-5-10-8(3)6-14-12(10)11(9)13;1-8(2)9-5-6-11-10(12(9)13)4-3-7-14-11;1-8(2)10-6-9-4-3-5-14-12(9)7-11(10)13;1-8(2)10-7-6-9-4-3-5-11(9)12(10)13;1-8(2)10-4-5-12-11(9(10)3)6-7-13-12;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-7(2)9-5-8-3-4-13-11(8)6-10(9)12;1-7(2)9-4-3-8-5-6-13-11(8)10(9)12;1-8(2)10-5-3-4-9-6-7-12-11(9)10;2*1-8(2)9-3-4-11-10(7-9)5-6-12-11;;;;;/h2*8-9H,5-7H2,1-4H3;4-5,8-9H,6-7H2,1-3H3;5-7,9H,8H2,1-4H3;7-9H,4-6H2,1-3H3;4-5,7-8H,6H2,1-3H3;5-6,8H,3-4,7H2,1-2H3;6-8H,3-5H2,1-2H3;3,5-8H,4H2,1-2H3;4-5,8H,6-7H2,1-3H3;5-6,8-9H,3-4,7H2,1-2H3;2*3-7H,1-2H3;3-8,12H,1-2H3;3-4,7-8H,5-6H2,1-2H3;3-8H,1-2H3;5*1H4
InChIKeySUQYQSAOWOLMQP-UHFFFAOYSA-N
XLogP61.15
TPSA156.74 Ų
H-Bond Donors1
H-Bond Acceptors14
Rotatable Bonds16
Heavy Atoms221
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003126.01
LogP ≤ 561.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1014

Analyze 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole with MolForge

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Related Compounds

5-chloro-3,3-difluoro-6-propan-2-yl-2,4-dihydrochromene;8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;5-chloro-8-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-chloro-6-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-2,3-dihydro-1-benzofuran;8-chloro-7-propan-2-yl-3,4-dihydro-2H-chromene;1-chloro-2-propan-2-ylnaphthalene;4,5-dimethyl-6-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;8-methyl-7-propan-2-yl-3,4-dihydro-2H-chromene;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;7-propan-2-yl-1H-indole;8-propan-2-ylquinoline
CID 158727880
7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;5-chloro-6-propan-2-yl-1,2,3,4-tetrahydronaphthalene;4,4-difluoro-6-propan-2-yl-2,3-dihydrochromene;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);7-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-methyl-6-propan-2-yl-1,2,3,4-tetrahydronaphthalene;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole
CID 159639477
6-chloro-3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;4-chloro-5-propan-2-yl-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;4-chloro-5-propan-2-yl-2,3-dihydro-1-benzofuran;5-chloro-6-propan-2-yl-2,3-dihydro-1H-indene;4,4-difluoro-6-propan-2-yl-2,3-dihydrochromene;3-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-2,3-dihydro-1H-indene;7-propan-2-yl-1H-indole
CID 161197002
5-chloro-3,3-difluoro-6-propan-2-yl-2,4-dihydrochromene;8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;5-chloro-8-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-chloro-6-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-2,3-dihydro-1-benzofuran;8-chloro-7-propan-2-yl-3,4-dihydro-2H-chromene;4,5-dimethyl-6-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;8-methyl-7-propan-2-yl-3,4-dihydro-2H-chromene;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;7-propan-2-yl-1H-indole;8-propan-2-ylquinoline
CID 161217142
1-chloro-2-[(E)-3-methylbut-1-enyl]benzene;1-chloro-3-[(E)-3-methylbut-1-enyl]benzene;1-chloro-4-[(E)-3-methylbut-1-enyl]benzene;1-fluoro-2-[(E)-3-methylbut-1-enyl]benzene;1-fluoro-3-[(E)-3-methylbut-1-enyl]benzene;1-fluoro-4-[(E)-3-methylbut-1-enyl]benzene;1-methoxy-2-[(E)-3-methylbut-1-enyl]benzene;1-methoxy-3-[(E)-3-methylbut-1-enyl]benzene;1-methoxy-4-[(E)-3-methylbut-1-enyl]benzene;[(E)-3-methylbut-1-enyl]benzene;2-[(E)-3-methylbut-1-enyl]furan;3-[(E)-3-methylbut-1-enyl]-1H-indole;2-[(E)-3-methylbut-1-enyl]pyridine;3-[(E)-3-methylbut-1-enyl]pyridine;4-[(E)-3-methylbut-1-enyl]pyridine;2-[(E)-3-methylbut-1-enyl]-1H-pyrrole;1-methyl-2-[(E)-3-methylbut-1-enyl]benzene;1-methyl-3-[(E)-3-methylbut-1-enyl]benzene;1-methyl-4-[(E)-3-methylbut-1-enyl]benzene;1-phenyl-3-propan-2-ylbenzene;1-phenyl-4-propan-2-ylbenzene
CID 159351868
4-chloro-5-propan-2-yl-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;bis(7-chloro-6-propan-2-yl-1-benzofuran);7-chloro-6-propan-2-yl-2,3-dihydro-1-benzofuran;1-chloro-2-propan-2-ylnaphthalene;5-chloro-8-propan-2-ylquinoline;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;7-fluoro-5-methyl-8-propan-2-ylquinoline;5-methoxy-6-propan-2-yl-3,4-dihydro-2H-chromene;3-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;bis(5-methyl-8-propan-2-ylquinoline);2-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophene;7-propan-2-yl-1H-indole;8-propan-2-ylquinoline
CID 160917424
7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;4-chloro-5-propan-2-yl-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-8-propan-2-ylquinoline;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;5-methoxy-6-propan-2-yl-3,4-dihydro-2H-chromene;3-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;4-methyl-8-propan-2-ylquinoline;5-methyl-8-propan-2-ylquinoline;2-propan-2-yl-5,6-dihydro-4H-cyclopenta[b]thiophene;7-propan-2-yl-1H-indole;8-propan-2-ylquinoline
CID 162163071

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole?
The IUPAC name of 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole (CID 160942354) is 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole.
What is the SMILES notation for 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole?
The canonical SMILES for 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole is C.C.C.C.C.CC(C)c1cc2c(cc1Cl)OCCC2.CC(C)c1cc2ccoc2cc1Cl.CC(C)c1ccc2c(c1)C(C)(C)CO2.CC(C)c1ccc2c(c1)C(C)(F)CCO2.CC(C)c1ccc2c(c1)CCCO2.CC(C)c1ccc2c(c1)CCO2.CC(C)c1ccc2c(c1Cl)C=CC2.CC(C)c1ccc2c(c1Cl)CCCO2.CC(C)c1ccc2c(c1Cl)OCC2C.CC(C)c1ccc2ccoc2c1Cl.CC(C)c1ccc2occc2c1.CC(C)c1cccc2cc[nH]c12.Cc1c(C(C)C)ccc2c1CCO2.Cc1cc(C(C)C)c(C)c2c1OCCC2.Cc1cc(C(C)C)c(C)c2c1OCCC2.Cc1cc2c(cc1C(C)C)CCCO2.
What is the InChIKey of 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole?
The InChIKey is SUQYQSAOWOLMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H20O.C13H17FO.2C13H18O.3C12H15ClO.C12H13Cl.2C12H16O.2C11H11ClO.C11H13N.C11H14O.C11H12O.5CH4/c2*1-9(2)13-8-10(3)14-12(11(13)4)6-5-7-15-14;1-9(2)10-4-5-12-11(8-10)13(3,14)6-7-15-12;1-9(2)10-5-6-12-11(7-10)13(3,4)8-14-12;1-9(2)12-8-11-5-4-6-14-13(11)7-10(12)3;1-7(2)9-4-5-10-8(3)6-14-12(10)11(9)13;1-8(2)9-5-6-11-10(12(9)13)4-3-7-14-11;1-8(2)10-6-9-4-3-5-14-12(9)7-11(10)13;1-8(2)10-7-6-9-4-3-5-11(9)12(10)13;1-8(2)10-4-5-12-11(9(10)3)6-7-13-12;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-7(2)9-5-8-3-4-13-11(8)6-10(9)12;1-7(2)9-4-3-8-5-6-13-11(8)10(9)12;1-8(2)10-5-3-4-9-6-7-12-11(9)10;2*1-8(2)9-3-4-11-10(7-9)5-6-12-11;;;;;/h2*8-9H,5-7H2,1-4H3;4-5,8-9H,6-7H2,1-3H3;5-7,9H,8H2,1-4H3;7-9H,4-6H2,1-3H3;4-5,7-8H,6H2,1-3H3;5-6,8H,3-4,7H2,1-2H3;6-8H,3-5H2,1-2H3;3,5-8H,4H2,1-2H3;4-5,8H,6-7H2,1-3H3;5-6,8-9H,3-4,7H2,1-2H3;2*3-7H,1-2H3;3-8,12H,1-2H3;3-4,7-8H,5-6H2,1-2H3;3-8H,1-2H3;5*1H4.
What are the key properties of 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole?
7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole has a molecular weight of 3126.01 g/mol, XLogP of 61.15, 16 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-methyl-6-propan-2-yl-2,3-dihydro-1-benzofuran;6-chloro-5-propan-2-yl-1-benzofuran;7-chloro-6-propan-2-yl-1-benzofuran;5-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;7-chloro-6-propan-2-yl-3,4-dihydro-2H-chromene;4-chloro-5-propan-2-yl-1H-indene;3,3-dimethyl-5-propan-2-yl-2H-1-benzofuran;bis(5,8-dimethyl-6-propan-2-yl-3,4-dihydro-2H-chromene);4-fluoro-4-methyl-6-propan-2-yl-2,3-dihydrochromene;methane;4-methyl-5-propan-2-yl-2,3-dihydro-1-benzofuran;7-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;5-propan-2-yl-1-benzofuran;5-propan-2-yl-2,3-dihydro-1-benzofuran;6-propan-2-yl-3,4-dihydro-2H-chromene;7-propan-2-yl-1H-indole is sourced from PubChem (CID 160942354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).